- InChI
- InChI=1S/C16H17Cl3O4/c17-10-8-12(18)16(13(19)9-10)23-15(21)7-3-6-14(20)22-11-4-1-2-5-11/h8-9,11H,1-7H2
- InChI Key
- YFJYWQFLHUQBRA-UHFFFAOYSA-N
- Formula
- C16H17Cl3O4
- SMILES
-
O=C(CCCC(=O)OC1CCCC1)Oc1c(Cl)c
c(Cl)cc1Cl - Molecular Weight1
- 379.66
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Pc : Critical Pressure (kPa).
- Inp : Non-polar retention indices.
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- Vc : Critical Volume (m3/kmol).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔfG° | -299.72 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -647.79 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 42.17 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 87.20 | kJ/mol | Joback Calculated Property |
| log10WS | -6.06 | Crippen Calculated Property | |
| logPoct/wat | 5.208 | Crippen Calculated Property | |
| McVol | 253.280 | ml/mol | McGowan Calculated Property |
| Pc | 1878.90 | kPa | Joback Calculated Property |
| Inp | [2574.00; 2574.00] |
|
|
| Inp | 2574.00 | NIST | |
| Inp | 2574.00 | NIST | |
| Tboil | 887.25 | K | Joback Calculated Property |
| Tc | 1120.89 | K | Joback Calculated Property |
| Tfus | 579.04 | K | Joback Calculated Property |
| Vc | 0.960 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [709.08; 762.47] | J/mol×K | [887.25; 1120.89] |
|
| Cp,gas | 709.08 | J/mol×K | 887.25 | Joback Calculated Property |
| Cp,gas | 721.04 | J/mol×K | 926.19 | Joback Calculated Property |
| Cp,gas | 731.75 | J/mol×K | 965.13 | Joback Calculated Property |
| Cp,gas | 741.22 | J/mol×K | 1004.07 | Joback Calculated Property |
| Cp,gas | 749.48 | J/mol×K | 1043.01 | Joback Calculated Property |
| Cp,gas | 756.55 | J/mol×K | 1081.95 | Joback Calculated Property |
| Cp,gas | 762.47 | J/mol×K | 1120.89 | Joback Calculated Property |
| η | [0.0000962; 0.0005341] | Pa×s | [579.04; 887.25] |
|
| η | 0.0005341 | Pa×s | 579.04 | Joback Calculated Property |
| η | 0.0003573 | Pa×s | 630.41 | Joback Calculated Property |
| η | 0.0002539 | Pa×s | 681.78 | Joback Calculated Property |
| η | 0.0001893 | Pa×s | 733.14 | Joback Calculated Property |
| η | 0.0001466 | Pa×s | 784.51 | Joback Calculated Property |
| η | 0.0001172 | Pa×s | 835.88 | Joback Calculated Property |
| η | 0.0000962 | Pa×s | 887.25 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, cyclopentyl 2,4,6-trichlorophenyl ester.
Sources
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